- InChI
- InChI=1S/C30H52O5Si3/c1-28-16-14-22(34-37(6,7)8)18-21(28)12-13-23-24-15-17-30(35-38(9,10)11,26(32)20-33-36(3,4)5)29(24,2)19-25(31)27(23)28/h14,18,23-24,27H,12-13,15-17,19-20H2,1-11H3/t23?,24?,27?,28-,29-,30-/m1/s1
- InChI Key
- FLOZJHDKJDRAEJ-VKNNHANSSA-N
- Formula
- C30H52O5Si3
- SMILES
-
CC12CC=C(O[Si](C)(C)C)C=C1CCC1
C2C(=O)CC2(C)C1CCC2(O[Si](C)(C )C)C(=O)CO[Si](C)(C)C - Molecular Weight1
- 576.99
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.7481 | Relay (1.0) Calculated Property | |
| ΔfG° | -175.68 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -1211.54 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 107.71 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.35 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.69 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.484 | Crippen Calculated Property | |
| Pc | -272.90 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 3276.00 | NIST | |
| Tboil | 704.31 | K | Relay (1.0) Calculated Property |
| Tc | 985.87 | K | Relay (1.0) Calculated Property |
| Tfus | 407.87 | K | Relay (1.0) Calculated Property |
| Vc | 1.759 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Cortisone enol-TMS.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- NIST Webbook
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